Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g54_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 1.A N LEU 2.A O no hydrogen 3.510 N/A GLU 4.A N TRP 1.A O no hydrogen 3.168 N/A VAL 7.A N GLU 4.A O no hydrogen 3.216 N/A ALA 8.A N SER 5.A O no hydrogen 3.164 N/A ARG 9.A NH1 THR 89.A O no hydrogen 3.213 N/A THR 11.A N GLN 15.A OE1 no hydrogen 3.043 N/A ARG 13.A NH1 GLU 108.A OE2 no hydrogen 3.060 N/A ARG 13.A NH1 THR 110.A OG1 no hydrogen 2.891 N/A GLN 15.A N THR 12.A OG1 no hydrogen 3.046 N/A GLY 16.A N THR 12.A O no hydrogen 3.055 N/A LEU 17.A N ARG 13.A O no hydrogen 2.800 N/A GLU 18.A N ALA 14.A O no hydrogen 2.906 N/A GLU 19.A N GLN 15.A O no hydrogen 3.208 N/A LEU 20.A N GLY 16.A O no hydrogen 2.930 N/A TYR 21.A N LEU 17.A O no hydrogen 2.830 N/A LYS 22.A N GLU 18.A O no hydrogen 3.294 N/A LYS 22.A NZ GLU 19.A OE1 no hydrogen 3.010 N/A LEU 23.A N GLU 19.A O no hydrogen 3.409 N/A LEU 23.A N LEU 20.A O no hydrogen 3.122 N/A TRP 24.A N TYR 21.A O no hydrogen 3.002 N/A GLY 25.A N LYS 22.A O no hydrogen 2.827 N/A TYR 26.A N TYR 21.A O no hydrogen 3.058 N/A ARG 27.A N ALA 211.A O no hydrogen 2.883 N/A THR 29.A N ASP 32.A OD2 no hydrogen 2.809 N/A THR 29.A OG1 ASP 32.A OD2 no hydrogen 2.952 N/A ILE 31.A N THR 29.A OG1 no hydrogen 3.132 N/A THR 33.A N THR 29.A O no hydrogen 3.215 N/A THR 33.A OG1 THR 29.A O no hydrogen 3.534 N/A THR 33.A OG1 ARG 30.A O no hydrogen 3.443 N/A MET 34.A N ILE 31.A O no hydrogen 3.246 N/A GLN 37.A NE2 CYS 45.A O no hydrogen 3.150 N/A SER 39.A OG PHE 43.A O no hydrogen 3.325 N/A THR 40.A OG1 ASP 32.A OD1 no hydrogen 2.793 N/A ILE 42.A N LEU 214.A O no hydrogen 3.040 N/A PHE 43.A N SER 41.A OG no hydrogen 3.018 N/A GLN 44.A N TRP 113.A O no hydrogen 2.805 N/A GLN 46.A N ASP 111.A O no hydrogen 2.862 N/A ARG 48.A N VAL 109.A O no hydrogen 2.994 N/A ARG 48.A NH1 GLN 46.A OE1 no hydrogen 2.796 N/A ARG 48.A NH1 ASP 111.A OD2 no hydrogen 2.694 N/A ARG 48.A NH2 ASP 111.A OD2 no hydrogen 3.006 N/A LEU 50.A N GLY 107.A O no hydrogen 2.793 N/A ASN 51.A N GLU 54.A OE1 no hydrogen 2.943 N/A GLU 54.A N ASN 51.A OD1 no hydrogen 2.795 N/A LEU 55.A N ASN 51.A O no hydrogen 2.894 N/A GLN 56.A N TRP 52.A O no hydrogen 3.056 N/A GLN 57.A N GLU 54.A O no hydrogen 2.931 N/A THR 58.A N LEU 55.A O no hydrogen 3.006 N/A THR 58.A OG1 HIS 60.A O no hydrogen 2.827 N/A HIS 60.A ND1 PRO 61.A O no hydrogen 3.266 N/A LEU 62.A N LEU 77.A O no hydrogen 3.189 N/A LEU 63.A N THR 110.A O no hydrogen 2.938 N/A LEU 64.A N VAL 75.A O no hydrogen 2.699 N/A THR 65.A N GLU 108.A O no hydrogen 3.097 N/A THR 65.A OG1 GLU 108.A OE2 no hydrogen 2.634 N/A LEU 66.A N ALA 73.A O no hydrogen 2.664 N/A GLN 67.A N LEU 104.A O no hydrogen 2.801 N/A HIS 68.A N GLN 71.A O no hydrogen 2.983 N/A GLN 71.A N HIS 68.A O no hydrogen 2.971 N/A ARG 72.A NE TYR 74.A OH no hydrogen 3.128 N/A ARG 72.A NH2 TYR 74.A OH no hydrogen 2.918 N/A ARG 72.A NH2 GLU 108.A OE2 no hydrogen 3.040 N/A ALA 73.A N LEU 66.A O no hydrogen 2.981 N/A TYR 74.A N MET 10.A O no hydrogen 2.909 N/A VAL 75.A N LEU 64.A O no hydrogen 3.047 N/A VAL 76.A N LEU 88.A O no hydrogen 2.943 N/A LEU 77.A N LEU 62.A O no hydrogen 2.687 N/A LEU 78.A N VAL 86.A O no hydrogen 2.878 N/A ASP 81.A N ARG 84.A O no hydrogen 3.024 N/A GLU 83.A N ASP 81.A OD1 no hydrogen 2.764 N/A ARG 84.A N ASP 81.A OD1 no hydrogen 2.976 N/A ARG 84.A NE ARG 84.A O no hydrogen 2.941 N/A VAL 85.A N PHE 96.A O no hydrogen 2.840 N/A VAL 86.A N GLU 79.A O no hydrogen 2.931 N/A LEU 87.A N LEU 94.A O no hydrogen 2.718 N/A LEU 88.A N VAL 76.A O no hydrogen 2.776 N/A THR 89.A N GLN 92.A O no hydrogen 3.069 N/A THR 89.A OG1 GLN 92.A O no hydrogen 3.431 N/A GLY 90.A N TYR 204.A OH no hydrogen 2.848 N/A GLU 91.A N THR 89.A OG1 no hydrogen 3.092 N/A GLN 92.A N THR 89.A OG1 no hydrogen 2.887 N/A ARG 93.A NH1.A LEU 195.A O no hydrogen 2.824 N/A ARG 93.A NH2.A LEU 195.A O no hydrogen 2.799 N/A LEU 94.A N LEU 87.A O no hydrogen 2.870 N/A PHE 96.A N VAL 85.A O no hydrogen 2.951 N/A THR 97.A N GLN 100.A OE1 no hydrogen 2.817 N/A THR 97.A OG1 GLN 100.A OE1 no hydrogen 3.375 N/A GLN 100.A N THR 97.A OG1 no hydrogen 3.058 N/A GLN 100.A NE2 GLU 4.A OE2 no hydrogen 2.930 N/A LEU 101.A N THR 97.A O no hydrogen 2.924 N/A MET 102.A N VAL 98.A O no hydrogen 2.848 N/A SER 103.A N SER 99.A O no hydrogen 3.132 N/A SER 103.A OG GLN 100.A O no hydrogen 2.769 N/A LEU 104.A N LEU 101.A O no hydrogen 3.034 N/A TRP 105.A N LEU 101.A O no hydrogen 2.777 N/A TRP 105.A NE1 GLU 108.A O no hydrogen 2.883 N/A VAL 109.A N ARG 48.A O no hydrogen 2.894 N/A THR 110.A N LEU 63.A O no hydrogen 2.740 N/A ASP 111.A N GLN 46.A O no hydrogen 2.712 N/A TRP 113.A N GLN 44.A O no hydrogen 3.069 N/A MET 115.A N ILE 42.A O no hydrogen 2.818 N/A LEU 117.A N GLN 183.A OE1 no hydrogen 2.782 N/A ARG 118.A NE MET 115.A O no hydrogen 2.899 N/A ARG 118.A NH1 SER 39.A OG no hydrogen 3.005 N/A ARG 118.A NH2 SER 39.A OG no hydrogen 3.218 N/A ARG 118.A NH2 ILE 42.A O no hydrogen 2.954 N/A LEU 121.A N ALA 174.A O no hydrogen 2.927 N/A GLY 124.A N PHE 151.A O no hydrogen 2.900 N/A MET 125.A N ARG 122.A O no hydrogen 3.039 N/A HIS 126.A N GLU 221.A O no hydrogen 2.913 N/A GLY 127.A N THR 149.A O no hydrogen 2.940 N/A ALA 129.A N LEU 219.A O no hydrogen 2.917 N/A ILE 130.A N GLY 127.A O no hydrogen 2.944 N/A GLU 131.A N GLY 127.A O no hydrogen 3.357 N/A VAL 132.A N GLU 128.A O no hydrogen 2.960 N/A LEU 133.A N ALA 129.A O no hydrogen 2.938 N/A ASP 134.A N ILE 130.A O no hydrogen 2.856 N/A GLN 135.A N GLU 131.A O no hydrogen 3.000 N/A LEU 136.A N VAL 132.A O no hydrogen 2.871 N/A LEU 137.A N LEU 133.A O no hydrogen 2.825 N/A ALA 138.A N ASP 134.A O no hydrogen 3.063 N/A LYS 139.A N GLN 135.A O no hydrogen 3.049 N/A LYS 139.A NZ SER 187.A O no hydrogen 2.899 N/A ALA 140.A N LEU 136.A O no hydrogen 2.924 N/A LEU 141.A N LEU 137.A O no hydrogen 2.884 N/A ASN 142.A N LYS 139.A O no hydrogen 3.392 N/A ASP 143.A N ALA 138.A O no hydrogen 2.994 N/A LEU 146.A N ASP 134.A OD1 no hydrogen 2.811 N/A THR 148.A N ASP 134.A OD2 no hydrogen 3.120 N/A THR 148.A OG1 GLN 150.A O no hydrogen 2.749 N/A THR 149.A OG1 GLU 131.A OE2 no hydrogen 2.892 N/A GLN 150.A N THR 148.A OG1 no hydrogen 2.976 N/A PHE 151.A N MET 125.A O no hydrogen 2.793 N/A LEU 155.A N ASN 152.A OD1 no hydrogen 2.881 N/A MET 156.A N ASN 152.A O no hydrogen 2.985 N/A GLN 157.A N ALA 153.A O no hydrogen 3.065 N/A ARG 158.A N GLU 154.A O no hydrogen 3.022 N/A ARG 158.A NH1 ASP 143.A OD2 no hydrogen 2.874 N/A ARG 158.A NH2 ASP 143.A OD1 no hydrogen 2.760 N/A VAL 159.A N LEU 155.A O no hydrogen 2.835 N/A GLU 160.A N MET 156.A O no hydrogen 2.925 N/A TRP 161.A N GLN 157.A O no hydrogen 2.974 N/A PHE 162.A N ARG 158.A O no hydrogen 3.031 N/A GLN 163.A N VAL 159.A O no hydrogen 2.811 N/A GLN 163.A NE2 ASP 171.A OD1 no hydrogen 2.975 N/A GLN 163.A NE2 THR 178.A OG1 no hydrogen 3.070 N/A ARG 164.A N GLU 160.A O no hydrogen 2.838 N/A TRP 165.A N TRP 161.A O no hydrogen 3.062 N/A GLN 166.A N PHE 162.A O no hydrogen 2.898 N/A ALA 167.A N ARG 164.A O no hydrogen 3.089 N/A MET 168.A N GLN 163.A O no hydrogen 2.917 N/A GLY 172.A N GLN 163.A OE1 no hydrogen 2.902 N/A ILE 173.A N ASP 171.A OD1 no hydrogen 2.913 N/A ALA 174.A N LEU 121.A O no hydrogen 2.880 N/A GLY 175.A N ILE 173.A O no hydrogen 2.989 N/A LEU 179.A N GLY 175.A O no hydrogen 2.857 N/A ALA 180.A N GLN 176.A O no hydrogen 2.869 N/A ARG 181.A N ARG 177.A O no hydrogen 3.034 N/A ARG 181.A NH2 GLN 166.A O no hydrogen 3.135 N/A LEU 182.A N THR 178.A O no hydrogen 2.951 N/A GLN 183.A N LEU 179.A O no hydrogen 2.949 N/A GLN 183.A NE2 LEU 117.A O no hydrogen 2.864 N/A GLN 183.A NE2 LEU 179.A O no hydrogen 3.006 N/A HIS 184.A N ALA 180.A O no hydrogen 3.008 N/A MET 185.A N ARG 181.A O no hydrogen 3.092 N/A MET 185.A N LEU 182.A O no hydrogen 3.222 N/A VAL 186.A N LEU 182.A O no hydrogen 3.013 N/A SER 187.A N GLU 190.A OE2 no hydrogen 3.123 N/A ARG 193.A N GLU 190.A O no hydrogen 3.095 N/A ARG 193.A NE GLU 190.A OE1 no hydrogen 2.528 N/A ARG 193.A NH2 GLU 190.A OE1 no hydrogen 2.981 N/A ALA 194.A N PRO 191.A O no hydrogen 3.039 N/A LEU 195.A N TRP 192.A O no hydrogen 3.040 N/A THR 196.A N ARG 193.A O no hydrogen 3.176 N/A THR 196.A OG1 ARG 193.A O no hydrogen 2.838 N/A TYR 204.A OH GLU 19.A OE2 no hydrogen 2.650 N/A GLU 206.A N ARG 203.A O no hydrogen 2.898 N/A ALA 211.A N GLY 25.A O no hydrogen 2.869 N/A ARG 215.A NH1 ASP 32.A OD1 no hydrogen 2.871 N/A ARG 215.A NH1 THR 40.A O no hydrogen 2.893 N/A ARG 215.A NH2 ASP 32.A OD1 no hydrogen 3.538 N/A ARG 215.A NH2 ASP 32.A OD2 no hydrogen 2.877 N/A GLU 221.A N HIS 126.A O no hydrogen 2.838 N/A